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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-bromo-5-(p-tolylmethylamino)-2H-pyridazin-3-one 4-bromo-5-(p-tolylmethylamino)-2…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.03 3.83 -12.44 2 4 0 58 294.152 3 ↓

Analogs

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Popular Name: 5-chloro-4-[(4-methoxy-3,5-dimethyl-phenyl)methyl-methyl-amino]-1H-pyridazin-6-one 5-chloro-4-[(4-methoxy-3,5-dimet…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.50 5.81 -9.93 1 5 0 58 307.781 4 ↓

Analogs

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Popular Name: 4-[[(1-tert-butyl-5-chloro-6-oxo-pyridazin-4-yl)amino]methyl]-N-methyl-benzamide 4-[[(1-tert-butyl-5-chloro-6-oxo…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.31 5.09 -20.12 2 6 0 76 348.834 5 ↓

Analogs

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Popular Name: 4-chloro-5-[[3-(isopropoxymethyl)phenyl]methylamino]-2-methyl-pyridazin-3-one 4-chloro-5-[[3-(isopropoxymethyl…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.60 6.12 -14.42 1 5 0 56 321.808 6 ↓

Analogs

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Popular Name: 5-chloro-4-[[4-(difluoromethoxy)-3-ethoxy-phenyl]methylamino]-1H-pyridazin-6-one 5-chloro-4-[[4-(difluoromethoxy)…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.03 3.47 -18.33 2 6 0 76 345.733 7 ↓

Analogs

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Popular Name: 5-chloro-4-[(2,3,4-trimethoxyphenyl)methylamino]-1H-pyridazin-6-one 5-chloro-4-[(2,3,4-trimethoxyphe…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.27 2.23 -17.88 2 7 0 85 325.752 6 ↓

Analogs

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Popular Name: 3-[[(1-tert-butyl-5-chloro-6-oxo-pyridazin-4-yl)-methyl-amino]methyl]benzamide 3-[[(1-tert-butyl-5-chloro-6-oxo…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.15 5.61 -13.56 2 6 0 81 348.834 5 ↓

Analogs

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Popular Name: 5-[[3-(tert-butoxymethyl)phenyl]methylamino]-4-chloro-2-methyl-pyridazin-3-one 5-[[3-(tert-butoxymethyl)phenyl]…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.04 6.5 -14.41 1 5 0 56 335.835 6 ↓

Analogs

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Popular Name: 4-chloro-5-[[4-(2-dimethylaminoethyloxy)phenyl]methylamino]-2-methyl-pyridazin-3-one 4-chloro-5-[[4-(2-dimethylaminoe…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.01 6.35 -46.69 2 6 1 61 337.831 7 ↓
Hi High (pH 8-9.5) 2.01 3.82 -15.38 1 6 0 59 336.823 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-chloro-4-[[3-(2,2-difluoroethoxy)phenyl]methylamino]-1H-pyridazin-6-one 5-chloro-4-[[3-(2,2-difluoroetho…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.05 3.62 -18.11 2 5 0 67 315.707 6 ↓

Analogs

37122312
37122312
37122314
37122314

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Popular Name: 5-chloro-4-[[(1S)-1-(3-chloro-4-fluoro-phenyl)ethyl]amino]-1H-pyridazin-6-one 5-chloro-4-[[(1S)-1-(3-chloro-4-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.78 4.34 -14.54 2 4 0 58 302.136 3 ↓

Analogs

37122312
37122312
37122314
37122314

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Popular Name: 5-chloro-4-[[(1R)-1-(3-chloro-4-fluoro-phenyl)ethyl]amino]-1H-pyridazin-6-one 5-chloro-4-[[(1R)-1-(3-chloro-4-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.78 4.33 -14.54 2 4 0 58 302.136 3 ↓

Analogs

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Popular Name: 4-chloro-5-[[(1S)-1-(3-chloro-4-fluoro-phenyl)ethyl]amino]-2-methyl-pyridazin-3-one 4-chloro-5-[[(1S)-1-(3-chloro-4-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.26 5.94 -14.81 1 4 0 47 316.163 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-5-[[(1R)-1-(3-chloro-4-fluoro-phenyl)ethyl]amino]-2-methyl-pyridazin-3-one 4-chloro-5-[[(1R)-1-(3-chloro-4-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.26 5.93 -14.8 1 4 0 47 316.163 3 ↓

Analogs

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Popular Name: 5-chloro-4-[(4-methylsulfanylphenyl)methylamino]-1H-pyridazin-6-one 5-chloro-4-[(4-methylsulfanylphe…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.88 4.1 -14.4 2 4 0 58 281.768 4 ↓

Analogs

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Popular Name: 4-chloro-2-methyl-5-[(4-methylsulfanylphenyl)methylamino]pyridazin-3-one 4-chloro-2-methyl-5-[(4-methylsu…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.36 5.7 -14.71 1 4 0 47 295.795 4 ↓

Analogs

25495842
25495842

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Popular Name: 5-chloro-4-[(2-nitrophenyl)methylamino]-1H-pyridazin-6-one 5-chloro-4-[(2-nitrophenyl)methy…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.36 3.78 -18.13 2 7 0 104 280.671 4 ↓

Analogs

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Popular Name: 5-[(4-bromo-2-chloro-phenyl)methylamino]-4-chloro-2-methyl-pyridazin-3-one 5-[(4-bromo-2-chloro-phenyl)meth…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.34 5.7 -14 1 4 0 47 363.042 3 ↓

Analogs

1953032
1953032

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Popular Name: 4-[(4-bromo-2-chloro-phenyl)methylamino]-5-chloro-1H-pyridazin-6-one 4-[(4-bromo-2-chloro-phenyl)meth…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.86 4.13 -13.93 2 4 0 58 349.015 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[(2-bromo-5-methoxy-phenyl)methylamino]-5-chloro-1H-pyridazin-6-one 4-[(2-bromo-5-methoxy-phenyl)met…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.24 2.94 -13.11 2 5 0 67 344.596 4 ↓

Analogs

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Popular Name: 4-chloro-5-[(3-methoxy-4-methyl-phenyl)methylamino]-2-methyl-pyridazin-3-one 4-chloro-5-[(3-methoxy-4-methyl-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.36 4.72 -14.64 1 5 0 56 293.754 4 ↓

Analogs

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Popular Name: 5-chloro-4-[(3-methoxy-4-methyl-phenyl)methylamino]-1H-pyridazin-6-one 5-chloro-4-[(3-methoxy-4-methyl-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.88 3.12 -14.3 2 5 0 67 279.727 4 ↓

Analogs

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Popular Name: 3-[[(5-chloro-6-oxo-1H-pyridazin-4-yl)-methyl-amino]methyl]benzamide 3-[[(5-chloro-6-oxo-1H-pyridazin…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.49 1.88 -18.43 3 6 0 92 292.726 4 ↓

Analogs

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Popular Name: 4-chloro-2-methyl-5-[(3-nitrophenyl)methylamino]pyridazin-3-one 4-chloro-2-methyl-5-[(3-nitrophe…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.86 5.39 -20.48 1 7 0 93 294.698 4 ↓

Analogs

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Popular Name: 5-chloro-4-[(3-nitrophenyl)methylamino]-1H-pyridazin-6-one 5-chloro-4-[(3-nitrophenyl)methy…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.38 3.79 -20.31 2 7 0 104 280.671 4 ↓

Analogs

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Popular Name: 5-chloro-4-[methyl-[(4-nitrophenyl)methyl]amino]-1H-pyridazin-6-one 5-chloro-4-[methyl-[(4-nitrophen…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.65 5.82 -14.54 1 7 0 95 294.698 4 ↓

Analogs

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Popular Name: 4-chloro-5-[(3-chlorophenyl)methylamino]-2-methyl-pyridazin-3-one 4-chloro-5-[(3-chlorophenyl)meth…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.58 5.18 -14.15 1 4 0 47 284.146 3 ↓

Analogs

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Popular Name: 4-chloro-5-[(4-fluorophenyl)methyl-methyl-amino]-2-methyl-pyridazin-3-one 4-chloro-5-[(4-fluorophenyl)meth…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.34 6.77 -10.6 0 4 0 38 281.718 3 ↓

Analogs

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Popular Name: 5-[(5-bromo-2-fluoro-phenyl)methylamino]-4-chloro-2-methyl-pyridazin-3-one 5-[(5-bromo-2-fluoro-phenyl)meth…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.83 5.32 -13.37 1 4 0 47 346.587 3 ↓

Analogs

42099894
42099894

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Popular Name: 4-[(1S)-1-[(5-chloro-1-methyl-6-oxo-pyridazin-4-yl)amino]ethyl]benzonitrile 4-[(1S)-1-[(5-chloro-1-methyl-6-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.24 5.76 -17.78 1 5 0 71 288.738 3 ↓

Analogs

42099893
42099893

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Popular Name: 4-[(1R)-1-[(5-chloro-1-methyl-6-oxo-pyridazin-4-yl)amino]ethyl]benzonitrile 4-[(1R)-1-[(5-chloro-1-methyl-6-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.24 5.75 -17.73 1 5 0 71 288.738 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[(5-chloro-6-oxo-1H-pyridazin-4-yl)amino]methyl]benzonitrile 3-[[(5-chloro-6-oxo-1H-pyridazin…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.18 3.46 -18.3 2 5 0 82 260.684 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[(5-chloro-1-methyl-6-oxo-pyridazin-4-yl)amino]methyl]benzonitrile 3-[[(5-chloro-1-methyl-6-oxo-pyr…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.66 5.06 -18.49 1 5 0 71 274.711 3 ↓

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